Spektraris NMR
Pallidone A
Common Name: Pallidone A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C25H32O5/c1-15(2)12-19(26)13-16(3)8-7-9-17(4)18(5)23-24(27)21-11-10-20(29-6)14-22(21)30-25(23)28/h9-11,13-15,18,27H,7-8,12H2,1-6H3/b16-13-,17-9+
InChIKey: InChIKey=YUOBFBRWMUVHBF-PXLBWSACSA-N
Formula: C25H32O5
Molecular Weight: 412.519526
Exact Mass: 412.224974
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Su, B.N., Takaishi, Y., Honda, G., Itoh, M., Takeda, Y., Kodzhimatov, O.K., Ashurmetov, O. J Nat Prod (2000) 63, 436-40
Species:
Notes: Family : Terpenoids, Type : Merosesquiterpenoids, Group : Farnesanes; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 1 (CH3) | 16.2 |
| 2 (CH) | 34 |
| 3 (C) | 140.5 |
| 4 (CH) | 126 |
| 5 (CH2) | 26.6 |
| 6 (CH2) | 23.1 |
| 7 (C) | 157.2 |
| 8 (CH) | 125 |
| 9 (C) | 200.8 |
| 10 (CH2) | 53.6 |
| 11 (CH) | 25.2 |
| 12 (CH3) | 22.7 |
| 13 (CH3) | 22.7 |
| 14 (CH3) | 25.4 |
| 15 (CH3) | 16.9 |
| 2' (C) | 167 |
| 3' (C) | 104.3 |
| 4' (C) | 162.8 |
| 5' (CH) | 124 |
| 6' (CH) | 112.1 |
| 7' (C) | 164 |
| 8' (CH) | 100.2 |
| 9' (C) | 154.4 |
| 10' (C) | 109.4 |
| 7'a (CH3) | 55.8 |
